Vitas-M small molecule compound
2-amino-4-{4-[(2-chlorobenzyl)oxy]-3-methoxyphenyl}-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STL169661
SMILES N#CC1=C(N)OC2=C(C1c1ccc(c(c1)OC)OCc1ccccc1Cl)C(=O)CC(C2)(C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C26H25ClN2O4 MW 464.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClN2O4/c1-26(2)11-19(30)24-22(12-26)33-25(29)17(13-28)23(24)15-8-9-20(21(10-15)31-3)32-14-16-6-4-5-7-18(16)27/h4-10,23H,11-12,14,29H2,1-3H3InChIKey
WGKYBYRSEBQIFJ-UHFFFAOYSA-NSynonyms
337498-97-22amino4(4((2chlorobenzyl)oxy)3methoxyphenyl)77dimethyl5oxo5678tetrahydro4Hchromene3carbonitrile
2AMINO4(4((2CHLOROPHENYL)METHOXY)3METHOXYPHENYL)77DIMETHYL5OXO68DIHYDRO4HCHROMENE3CARBONITRILE
337498972
CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)OCC4=CC=CC=C4Cl)OC)C(=O)C1)C
InChI=1SC26H25ClN2O4c126(2)1119(30)2422(1226)3325(29)17(1328)23(24)158920(21(1015)313)321416645718(16)27h41023H11121429H213H3
MFCD02046953
ZINC000000644048
ZINC000000644050
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